V013-9087 Screening compound: N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl)piperazine-1-carboxamide

V013-9087 Screening compound: N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl)piperazine-1-carboxamide
V013-9087 Screening compound: N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl)piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-9087
N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl)piperazine-1-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V013-9087

Molecular Formula

C28H36FN5O4 (C28 H36 FN5 O4)

Compound Name

N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl)piperazine-1-carboxamide

IUPAC name

N-cyclohexyl-4-(2-{[(4-fluorophenyl)methyl]carbamoyl}-4-(2-methoxyacetamido)phenyl)piperazine-1-carboxamide

SMILES

COCC(Nc(cc1)cc(C(NCc(cc2)ccc2F)=O)c1N(CC1)CCN1C(NC1CCCCC1)=O)=O

InChI

InChI=1S/C28H36FN5O4/c1-38-19-26(35)31-23-11-12-25(24(17-23)27(36)30-18-20-7-9-21(29)10-8-20)33-13-15-34(16-14-33)28(37)32-22-5-3-2-4-6-22/h7-12,17,22H,2-6,13-16,18-19H2,1H3,(H,30,36)(H,31,35)(H,32,37)

InChI Key

SLRAXAHNTLWFHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14259181

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

525.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.896

Distribution Coefficient, logD

3.895

Water Solubility, LogSw

-4.02

Polar Surface Area

85.701

Acid Dissociation Constant (pKa)

10.94

Base Dissociation Constant (pKb)

7.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.40

References: we are preparing a list of scientific research reports with V013-9087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-9087?
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What is the minimum amount of V013-9087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-9087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-9087
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V013-9087 available by request